N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)sulfanyl-propanamide

Systemtic Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)sulfanyl-propanamide Openeye Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)sulfanyl-propanamide CAS Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-[(4-methoxyphenyl)thio]propanamide IUPAC Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-(4-methoxyphenyl)sulfanylpropanamide Traditional Name: N-(3,4-diethyl-1,3-benzothiazol-2-ylidene)-3-[(4-methoxyphenyl)thio]propionamide Formula: C21H24N2O2S2 MolecularWeight: 400.55746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=NC(=O)CCSC3=CC=C(C=C3)OC)N2CC

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=NC(=O)CCSC3=CC=C(C=C3)OC)N2CC

InChI

InChI=1S/C21H24N2O2S2/c1-4-15-7-6-8-18-20(15)23(5-2)21(27-18)22-19(24)13-14-26-17-11-9-16(25-3)10-12-17/h6-12H,4-5,13-14H2,1-3H3