N-[5-(2,3-dihydro-1H-inden-1-ylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide

Systemtic Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-N-methyl-benzamide Openeye Name: N-[3-(1H-imidazol-2-ylmethylamino)-4-(indan-1-ylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide CAS Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-4-(1H-imidazol-2-ylmethylamino)-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-N-methylbenzamide IUPAC Name: N-[5-(2,3-dihydro-1H-inden-1-ylamino)-4-(1H-imidazol-2-ylmethylamino)-1-(1-naphthalen-1-ylethylamino)-1-oxopentan-2-yl]-N-methylbenzamide Traditional Name: N-[3-(1H-imidazol-2-ylmethylamino)-4-(indan-1-ylamino)-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-N-methyl-benzamide Formula: C38H42N6O2 MolecularWeight: 614.77908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNC3CCC4=CC=CC=C34)NCC5=NC=CN5)N(C)C(=O)C6=CC=CC=C6

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CC(CNC3CCC4=CC=CC=C34)NCC5=NC=CN5)N(C)C(=O)C6=CC=CC=C6

InChI

InChI=1S/C38H42N6O2/c1-26(31-18-10-15-27-11-6-8-16-32(27)31)43-37(45)35(44(2)38(46)29-13-4-3-5-14-29)23-30(41-25-36-39-21-22-40-36)24-42-34-20-19-28-12-7-9-17-33(28)34/h3-18,21-22,26,30,34-35,41-42H,19-20,23-25H2,1-2H3,(H,39,40)(H,43,45)