4-[3-[(4-carbamimidoylphenyl)amino]prop-1-ynyl]-N,2,5-trimethyl-N-phenyl-benzamide

Systemtic Name: 4-[3-[(4-carbamimidoylphenyl)amino]prop-1-ynyl]-N,2,5-trimethyl-N-phenyl-benzamide Openeye Name: 4-[3-(4-carbamimidoylanilino)prop-1-ynyl]-N,2,5-trimethyl-N-phenyl-benzamide CAS Name: 4-[3-(4-carbamimidoylanilino)prop-1-ynyl]-N,2,5-trimethyl-N-phenylbenzamide IUPAC Name: 4-[3-(4-carbamimidoylanilino)prop-1-ynyl]-N,2,5-trimethyl-N-phenylbenzamide Traditional Name: 4-[3-(4-amidinoanilino)prop-1-ynyl]-N,2,5-trimethyl-N-phenyl-benzamide Formula: C26H26N4O MolecularWeight: 410.51084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#CCNC2=CC=C(C=C2)C(=N)N)C)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1C#CCNC2=CC=C(C=C2)C(=N)N)C)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C26H26N4O/c1-18-17-24(26(31)30(3)23-9-5-4-6-10-23)19(2)16-21(18)8-7-15-29-22-13-11-20(12-14-22)25(27)28/h4-6,9-14,16-17,29H,15H2,1-3H3,(H3,27,28)