N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(6-ethyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(6-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=CC2=C(C=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C

InChI

InChI=1S/C21H24N2O2S2/c1-4-15-7-12-18-19(14-15)27-21(23(18)2)22-20(24)6-5-13-26-17-10-8-16(25-3)9-11-17/h7-12,14H,4-6,13H2,1-3H3