N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(4-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butyramide Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)OC)N2C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=NC(=O)CCCSC3=CC=C(C=C3)OC)N2C

InChI

InChI=1S/C21H24N2O2S2/c1-4-15-7-5-8-18-20(15)23(2)21(27-18)22-19(24)9-6-14-26-17-12-10-16(25-3)11-13-17/h5,7-8,10-13H,4,6,9,14H2,1-3H3