N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]thiophene-3-carboxamide

Systemtic Name: N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]thiophene-3-carboxamide Openeye Name: N-[4-[2-[4-(m-tolyl)piperazin-1-yl]-2-oxo-ethyl]thiazol-2-yl]thiophene-3-carboxamide CAS Name: N-[4-[2-[4-(3-methylphenyl)-1-piperazinyl]-2-oxoethyl]-2-thiazolyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-thiazol-2-yl]thiophene-3-carboxamide Traditional Name: N-[4-[2-keto-2-[4-(m-tolyl)piperazino]ethyl]thiazol-2-yl]thiophene-3-carboxamide Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=CSC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CC3=CSC(=N3)NC(=O)C4=CSC=C4

InChI

InChI=1S/C21H22N4O2S2/c1-15-3-2-4-18(11-15)24-6-8-25(9-7-24)19(26)12-17-14-29-21(22-17)23-20(27)16-5-10-28-13-16/h2-5,10-11,13-14H,6-9,12H2,1H3,(H,22,23,27)