N-but-3-yn-2-yl-4-[3-[(3-carbamimidoylphenyl)-methyl-amino]prop-1-ynyl]-2-methyl-benzamide

Systemtic Name: N-but-3-yn-2-yl-4-[3-[(3-carbamimidoylphenyl)-methyl-amino]prop-1-ynyl]-2-methyl-benzamide Openeye Name: 4-[3-(3-carbamimidoyl-N-methyl-anilino)prop-1-ynyl]-2-methyl-N-(1-methylprop-2-ynyl)benzamide CAS Name: N-but-3-yn-2-yl-4-[3-(3-carbamimidoyl-N-methylanilino)prop-1-ynyl]-2-methylbenzamide IUPAC Name: N-but-3-yn-2-yl-4-[3-(3-carbamimidoyl-N-methylanilino)prop-1-ynyl]-2-methylbenzamide Traditional Name: 4-[3-(3-amidino-N-methyl-anilino)prop-1-ynyl]-2-methyl-N-(1-methylprop-2-ynyl)benzamide Formula: C23H24N4O MolecularWeight: 372.46286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C(=N)N)C(=O)NC(C)C#C

Isomeric SMILES

CC1=C(C=CC(=C1)C#CCN(C)C2=CC=CC(=C2)C(=N)N)C(=O)NC(C)C#C

InChI

InChI=1S/C23H24N4O/c1-5-17(3)26-23(28)21-12-11-18(14-16(21)2)8-7-13-27(4)20-10-6-9-19(15-20)22(24)25/h1,6,9-12,14-15,17H,13H2,2-4H3,(H3,24,25)(H,26,28)