[4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(5-nitrothiophen-2-yl)methanone

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(5-nitrothiophen-2-yl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(5-nitro-2-thienyl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-(5-nitro-2-thiophenyl)methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(5-nitrothiophen-2-yl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(5-nitro-2-thienyl)methanone Formula: C17H21N3O3S2 MolecularWeight: 379.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O3S2/c1-17(2,3)13-10-24-15(18-13)11-6-8-19(9-7-11)16(21)12-4-5-14(25-12)20(22)23/h4-5,10-11H,6-9H2,1-3H3