[4-(cyclopropylamino)-3-nitro-phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-thiophen-2-ylcarbonylpiperazin-1-yl)methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(2-thenoyl)piperazino]methanone Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O4S/c24-18(13-3-6-15(20-14-4-5-14)16(12-13)23(26)27)21-7-9-22(10-8-21)19(25)17-2-1-11-28-17/h1-3,6,11-12,14,20H,4-5,7-10H2