3-azanyl-N-(3-cyanophenyl)-4-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-5-propan-2-ylimino-2H-thiophene-2-carboxamide

Systemtic Name: 3-azanyl-N-(3-cyanophenyl)-4-[4-(diphenylmethyl)piperazin-1-yl]carbonyl-5-propan-2-ylimino-2H-thiophene-2-carboxamide Openeye Name: 3-amino-4-(4-benzhydrylpiperazine-1-carbonyl)-N-(3-cyanophenyl)-5-isopropylimino-2H-thiophene-2-carboxamide CAS Name: 3-amino-N-(3-cyanophenyl)-4-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]-5-propan-2-ylimino-2H-thiophene-2-carboxamide IUPAC Name: 3-amino-4-(4-benzhydrylpiperazine-1-carbonyl)-N-(3-cyanophenyl)-5-propan-2-ylimino-2H-thiophene-2-carboxamide Traditional Name: 3-amino-4-(4-benzhydrylpiperazine-1-carbonyl)-N-(3-cyanophenyl)-5-isopropylimino-2H-thiophene-2-carboxamide Formula: C33H34N6O2S MolecularWeight: 578.72706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C1C(=C(C(S1)C(=O)NC2=CC=CC(=C2)C#N)N)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)N=C1C(=C(C(S1)C(=O)NC2=CC=CC(=C2)C#N)N)C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H34N6O2S/c1-22(2)36-32-27(28(35)30(42-32)31(40)37-26-15-9-10-23(20-26)21-34)33(41)39-18-16-38(17-19-39)29(24-11-5-3-6-12-24)25-13-7-4-8-14-25/h3-15,20,22,29-30H,16-19,35H2,1-2H3,(H,37,40)