[4-[(4-cyclopropyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone

Systemtic Name: [4-[(4-cyclopropyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Openeye Name: [4-[(4-cyclopropylthiazol-2-yl)methyl]piperazin-1-yl]-(5-nitro-2-furyl)methanone CAS Name: [4-[(4-cyclopropyl-2-thiazolyl)methyl]-1-piperazinyl]-(5-nitro-2-furanyl)methanone IUPAC Name: [4-[(4-cyclopropyl-1,3-thiazol-2-yl)methyl]piperazin-1-yl]-(5-nitrofuran-2-yl)methanone Traditional Name: [4-[(4-cyclopropylthiazol-2-yl)methyl]piperazino]-(5-nitro-2-furyl)methanone Formula: C16H18N4O4S MolecularWeight: 362.40352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC(=N2)CN3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C2=CSC(=N2)CN3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O4S/c21-16(13-3-4-15(24-13)20(22)23)19-7-5-18(6-8-19)9-14-17-12(10-25-14)11-1-2-11/h3-4,10-11H,1-2,5-9H2