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

Systemtic Name: N-[3-[1,3-benzothiazol-2-yl-(4-ethylphenyl)amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-3-keto-propyl]thiophene-2-carboxamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)C4=CC=CS4

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C23H21N3O2S2/c1-2-16-9-11-17(12-10-16)26(23-25-18-6-3-4-7-19(18)30-23)21(27)13-14-24-22(28)20-8-5-15-29-20/h3-12,15H,2,13-14H2,1H3,(H,24,28)