2-[(4S)-5-[(2R)-2-[3-[(2S)-2,3-dihydro-1,3-thiazol-2-yl]-3-oxidanylidene-propyl]piperidin-1-yl]-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxidanylidene-pentyl]guanidine

Systemtic Name: 2-[(4S)-5-[(2R)-2-[3-[(2S)-2,3-dihydro-1,3-thiazol-2-yl]-3-oxidanylidene-propyl]piperidin-1-yl]-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxidanylidene-pentyl]guanidine Openeye Name: 2-[(4S)-5-[(2R)-2-[3-[(2S)-2,3-dihydrothiazol-2-yl]-3-oxo-propyl]-1-piperidyl]-4-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-5-oxo-pentyl]guanidine CAS Name: 2-[(4S)-5-[(2R)-2-[3-[(2S)-2,3-dihydrothiazol-2-yl]-3-oxopropyl]-1-piperidinyl]-4-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-5-oxopentyl]guanidine IUPAC Name: 2-[(4S)-5-[(2R)-2-[3-[(2S)-2,3-dihydro-1,3-thiazol-2-yl]-3-oxopropyl]piperidin-1-yl]-4-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-5-oxopentyl]guanidine Traditional Name: 2-[(4S)-5-keto-5-[(2R)-2-[3-keto-3-[(2S)-4-thiazolin-2-yl]propyl]piperidino]-4-(naphthionylamino)pentyl]guanidine Formula: C29H41N7O4S2 MolecularWeight: 615.81034

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CCCN=C(N)N)C(=O)N3CCCCC3CCC(=O)C4NC=CS4

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](CCCN=C(N)N)C(=O)N3CCCC[C@@H]3CCC(=O)[C@H]4NC=CS4

InChI

InChI=1S/C29H41N7O4S2/c1-35(2)24-12-5-10-22-21(24)9-6-13-26(22)42(39,40)34-23(11-7-16-33-29(30)31)28(38)36-18-4-3-8-20(36)14-15-25(37)27-32-17-19-41-27/h5-6,9-10,12-13,17,19-20,23,27,32,34H,3-4,7-8,11,14-16,18H2,1-2H3,(H4,30,31,33)/t20-,23+,27+/m1/s1