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

Systemtic Name: N-[3-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazino]-3-keto-propyl]thiophene-2-carboxamide Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H24N4O2S2/c1-15(21-23-16-5-2-3-6-17(16)29-21)24-10-12-25(13-11-24)19(26)8-9-22-20(27)18-7-4-14-28-18/h2-7,14-15H,8-13H2,1H3,(H,22,27)