N-[5-[[aminocarbonyl(2-naphthalen-2-ylethyl)carbamoyl]amino]-2-(4-cyclohexylpiperazin-1-yl)phenyl]-4-phenyl-butanamide

Systemtic Name: N-[5-[[aminocarbonyl(2-naphthalen-2-ylethyl)carbamoyl]amino]-2-(4-cyclohexylpiperazin-1-yl)phenyl]-4-phenyl-butanamide Openeye Name: N-[5-[[carbamoyl-[2-(2-naphthyl)ethyl]carbamoyl]amino]-2-(4-cyclohexylpiperazin-1-yl)phenyl]-4-phenyl-butanamide CAS Name: N-[5-[[[carbamoyl-[2-(2-naphthalenyl)ethyl]amino]-oxomethyl]amino]-2-(4-cyclohexyl-1-piperazinyl)phenyl]-4-phenylbutanamide IUPAC Name: N-[5-[[carbamoyl(2-naphthalen-2-ylethyl)carbamoyl]amino]-2-(4-cyclohexylpiperazin-1-yl)phenyl]-4-phenylbutanamide Traditional Name: N-[5-[[carbamoyl-[2-(2-naphthyl)ethyl]carbamoyl]amino]-2-(4-cyclohexylpiperazino)phenyl]-4-phenyl-butyramide Formula: C40H48N6O3 MolecularWeight: 660.84752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)N(CCC4=CC5=CC=CC=C5C=C4)C(=O)N)NC(=O)CCCC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)N(CCC4=CC5=CC=CC=C5C=C4)C(=O)N)NC(=O)CCCC6=CC=CC=C6

InChI

InChI=1S/C40H48N6O3/c41-39(48)46(23-22-31-18-19-32-13-7-8-14-33(32)28-31)40(49)42-34-20-21-37(45-26-24-44(25-27-45)35-15-5-2-6-16-35)36(29-34)43-38(47)17-9-12-30-10-3-1-4-11-30/h1,3-4,7-8,10-11,13-14,18-21,28-29,35H,2,5-6,9,12,15-17,22-27H2,(H2,41,48)(H,42,49)(H,43,47)