N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidino]-4-keto-butyl]thiophene-3-carboxamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCCNC(=O)C4=CSC=C4

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCCNC(=O)C4=CSC=C4

InChI

InChI=1S/C21H23N3O2S2/c25-19(6-3-10-22-20(26)16-9-13-27-14-16)24-11-7-15(8-12-24)21-23-17-4-1-2-5-18(17)28-21/h1-2,4-5,9,13-15H,3,6-8,10-12H2,(H,22,26)