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

Systemtic Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Openeye Name: [4-(4-tert-butylthiazol-2-yl)-1-piperidyl]-(3-pyrrol-1-yl-2-thienyl)methanone CAS Name: [4-(4-tert-butyl-2-thiazolyl)-1-piperidinyl]-[3-(1-pyrrolyl)-2-thiophenyl]methanone IUPAC Name: [4-(4-tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-(3-pyrrol-1-ylthiophen-2-yl)methanone Traditional Name: [4-(4-tert-butylthiazol-2-yl)piperidino]-(3-pyrrol-1-yl-2-thienyl)methanone Formula: C21H25N3OS2 MolecularWeight: 399.5727

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(C=CS3)N4C=CC=C4

InChI

InChI=1S/C21H25N3OS2/c1-21(2,3)17-14-27-19(22-17)15-6-11-24(12-7-15)20(25)18-16(8-13-26-18)23-9-4-5-10-23/h4-5,8-10,13-15H,6-7,11-12H2,1-3H3