4-[2-[3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]-3-oxidanylidene-3-piperidin-1-yl-propyl]benzenecarboximidamide

Systemtic Name: 4-[2-[3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]-3-oxidanylidene-3-piperidin-1-yl-propyl]benzenecarboximidamide Openeye Name: 4-[2-[3-[(7-methoxy-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]-3-oxo-3-(1-piperidyl)propyl]benzamidine CAS Name: 4-[2-[3-[(7-methoxy-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]-3-oxo-3-(1-piperidinyl)propyl]benzenecarboximidamide IUPAC Name: 4-[2-[3-[(7-methoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]-3-oxo-3-piperidin-1-ylpropyl]benzenecarboximidamide Traditional Name: 4-[3-keto-2-[2-keto-3-[(7-methoxy-2-naphthyl)sulfonylamino]pyrrolidino]-3-piperidino-propyl]benzamidine Formula: C30H35N5O5S MolecularWeight: 577.6944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)N5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)N5CCCCC5

InChI

InChI=1S/C30H35N5O5S/c1-40-24-11-9-21-10-12-25(19-23(21)18-24)41(38,39)33-26-13-16-35(29(26)36)27(30(37)34-14-3-2-4-15-34)17-20-5-7-22(8-6-20)28(31)32/h5-12,18-19,26-27,33H,2-4,13-17H2,1H3,(H3,31,32)