4-azanyl-3-[[3-[(7-methoxynaphthalen-2-yl)sulfonyl-(pyridin-2-ylmethyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-azanyl-3-[[3-[(7-methoxynaphthalen-2-yl)sulfonyl-(pyridin-2-ylmethyl)amino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide Openeye Name: 4-amino-3-[[3-[(7-methoxy-2-naphthyl)sulfonyl-(2-pyridylmethyl)amino]-2-oxo-pyrrolidin-1-yl]methyl]benzamidine CAS Name: 4-amino-3-[[3-[(7-methoxy-2-naphthalenyl)sulfonyl-(2-pyridinylmethyl)amino]-2-oxo-1-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 4-amino-3-[[3-[(7-methoxynaphthalen-2-yl)sulfonyl-(pyridin-2-ylmethyl)amino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide Traditional Name: 4-amino-3-[[2-keto-3-[(7-methoxy-2-naphthyl)sulfonyl-(2-pyridylmethyl)amino]pyrrolidino]methyl]benzamidine Formula: C29H30N6O4S MolecularWeight: 558.6513

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=N3)C4CCN(C4=O)CC5=C(C=CC(=C5)C(=N)N)N

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)S(=O)(=O)N(CC3=CC=CC=N3)C4CCN(C4=O)CC5=C(C=CC(=C5)C(=N)N)N

InChI

InChI=1S/C29H30N6O4S/c1-39-24-8-5-19-6-9-25(16-21(19)15-24)40(37,38)35(18-23-4-2-3-12-33-23)27-11-13-34(29(27)36)17-22-14-20(28(31)32)7-10-26(22)30/h2-10,12,14-16,27H,11,13,17-18,30H2,1H3,(H3,31,32)