N-[[4-carbamimidoyl-2-[[3-(methylamino)-3-oxidanylidene-propyl]amino]phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide

Systemtic Name: N-[[4-carbamimidoyl-2-[[3-(methylamino)-3-oxidanylidene-propyl]amino]phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide Openeye Name: N-[[4-carbamimidoyl-2-[[3-(methylamino)-3-oxo-propyl]amino]phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide CAS Name: N-[[4-carbamimidoyl-2-[[3-(methylamino)-3-oxopropyl]amino]phenyl]methyl]-3,5-dimethoxy-4-methylbenzamide IUPAC Name: N-[[4-carbamimidoyl-2-[[3-(methylamino)-3-oxopropyl]amino]phenyl]methyl]-3,5-dimethoxy-4-methylbenzamide Traditional Name: N-[4-amidino-2-[[3-keto-3-(methylamino)propyl]amino]benzyl]-3,5-dimethoxy-4-methyl-benzamide Formula: C22H29N5O4 MolecularWeight: 427.49676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCCC(=O)NC)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCCC(=O)NC)OC

InChI

InChI=1S/C22H29N5O4/c1-13-18(30-3)10-16(11-19(13)31-4)22(29)27-12-15-6-5-14(21(23)24)9-17(15)26-8-7-20(28)25-2/h5-6,9-11,26H,7-8,12H2,1-4H3,(H3,23,24)(H,25,28)(H,27,29)