N-[4-(diethylamino)-2-methyl-phenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(diethylamino)-2-methyl-phenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]ethanamide Openeye Name: N-[4-(diethylamino)-2-methyl-phenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]acetamide CAS Name: N-[4-(diethylamino)-2-methylphenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]acetamide IUPAC Name: N-[4-(diethylamino)-2-methylphenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)sulfanyl]acetamide Traditional Name: N-[4-(diethylamino)-2-methyl-phenyl]-2-[(2-phenyl-3H-1,5-benzodiazepin-4-yl)thio]acetamide Formula: C28H30N4OS MolecularWeight: 470.629

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=CC=C4)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N=C(C2)C4=CC=CC=C4)C

InChI

InChI=1S/C28H30N4OS/c1-4-32(5-2)22-15-16-23(20(3)17-22)30-27(33)19-34-28-18-26(21-11-7-6-8-12-21)29-24-13-9-10-14-25(24)31-28/h6-17H,4-5,18-19H2,1-3H3,(H,30,33)