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

Systemtic Name: N-[[4-carbamimidoyl-2-[(2-oxidanylidene-2-phenylazanyl-ethyl)amino]phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide Openeye Name: N-[[2-[(2-anilino-2-oxo-ethyl)amino]-4-carbamimidoyl-phenyl]methyl]-3,5-dimethoxy-4-methyl-benzamide CAS Name: N-[[2-[(2-anilino-2-oxoethyl)amino]-4-carbamimidoylphenyl]methyl]-3,5-dimethoxy-4-methylbenzamide IUPAC Name: N-[[2-[(2-anilino-2-oxoethyl)amino]-4-carbamimidoylphenyl]methyl]-3,5-dimethoxy-4-methylbenzamide Traditional Name: N-[4-amidino-2-[(2-anilino-2-keto-ethyl)amino]benzyl]-3,5-dimethoxy-4-methyl-benzamide Formula: C26H29N5O4 MolecularWeight: 475.53956

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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)NCC(=O)NC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)NCC2=C(C=C(C=C2)C(=N)N)NCC(=O)NC3=CC=CC=C3)OC

InChI

InChI=1S/C26H29N5O4/c1-16-22(34-2)12-19(13-23(16)35-3)26(33)30-14-18-10-9-17(25(27)28)11-21(18)29-15-24(32)31-20-7-5-4-6-8-20/h4-13,29H,14-15H2,1-3H3,(H3,27,28)(H,30,33)(H,31,32)