N-(3-chloranyl-4-methyl-phenyl)-4-[3-(dimethylamino)propylcarbamoylamino]-3-phenyl-butanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[3-(dimethylamino)propylcarbamoylamino]-3-phenyl-butanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-[3-(dimethylamino)propylcarbamoylamino]-3-phenyl-butanamide CAS Name: N-(3-chloro-4-methylphenyl)-4-[[[3-(dimethylamino)propylamino]-oxomethyl]amino]-3-phenylbutanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-[3-(dimethylamino)propylcarbamoylamino]-3-phenylbutanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-[3-(dimethylamino)propylcarbamoylamino]-3-phenyl-butyramide Formula: C23H31ClN4O2 MolecularWeight: 430.97084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(CNC(=O)NCCCN(C)C)C2=CC=CC=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC(CNC(=O)NCCCN(C)C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C23H31ClN4O2/c1-17-10-11-20(15-21(17)24)27-22(29)14-19(18-8-5-4-6-9-18)16-26-23(30)25-12-7-13-28(2)3/h4-6,8-11,15,19H,7,12-14,16H2,1-3H3,(H,27,29)(H2,25,26,30)