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

Systemtic Name: N-[4-[1,3-benzothiazol-2-yl-(4-ethylphenyl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[N-(1,3-benzothiazol-2-yl)-4-ethylanilino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-[N-(1,3-benzothiazol-2-yl)-4-ethyl-anilino]-4-keto-butyl]thiophene-3-carboxamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCNC(=O)C4=CSC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)CCCNC(=O)C4=CSC=C4

InChI

InChI=1S/C24H23N3O2S2/c1-2-17-9-11-19(12-10-17)27(24-26-20-6-3-4-7-21(20)31-24)22(28)8-5-14-25-23(29)18-13-15-30-16-18/h3-4,6-7,9-13,15-16H,2,5,8,14H2,1H3,(H,25,29)