[3-azanyl-5-phenylazanyl-4-(4-phenylpiperazin-1-yl)carbonyl-thiophen-2-yl]-(3-methoxyphenyl)methanone

Systemtic Name: [3-azanyl-5-phenylazanyl-4-(4-phenylpiperazin-1-yl)carbonyl-thiophen-2-yl]-(3-methoxyphenyl)methanone Openeye Name: [3-amino-5-anilino-4-(4-phenylpiperazine-1-carbonyl)-2-thienyl]-(3-methoxyphenyl)methanone CAS Name: [3-amino-5-anilino-4-[oxo-(4-phenyl-1-piperazinyl)methyl]-2-thiophenyl]-(3-methoxyphenyl)methanone IUPAC Name: [3-amino-5-anilino-4-(4-phenylpiperazine-1-carbonyl)thiophen-2-yl]-(3-methoxyphenyl)methanone Traditional Name: [3-amino-5-anilino-4-(4-phenylpiperazine-1-carbonyl)-2-thienyl]-(3-methoxyphenyl)methanone Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)C2=C(C(=C(S2)NC3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)C2=C(C(=C(S2)NC3=CC=CC=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5)N

InChI

InChI=1S/C29H28N4O3S/c1-36-23-14-8-9-20(19-23)26(34)27-25(30)24(28(37-27)31-21-10-4-2-5-11-21)29(35)33-17-15-32(16-18-33)22-12-6-3-7-13-22/h2-14,19,31H,15-18,30H2,1H3