[4-(cyclopropylamino)-3-nitro-phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: [4-(cyclopropylamino)-3-nitro-phenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Openeye Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-thiazol-2-ylpiperazin-1-yl)methanone CAS Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-(2-thiazolyl)-1-piperazinyl]methanone IUPAC Name: [4-(cyclopropylamino)-3-nitrophenyl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone Traditional Name: [4-(cyclopropylamino)-3-nitro-phenyl]-(4-thiazol-2-ylpiperazino)methanone Formula: C17H19N5O3S MolecularWeight: 373.42946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5O3S/c23-16(20-6-8-21(9-7-20)17-18-5-10-26-17)12-1-4-14(19-13-2-3-13)15(11-12)22(24)25/h1,4-5,10-11,13,19H,2-3,6-9H2