3-chloranyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-chloranyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-methyl-benzamide Openeye Name: 3-chloro-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]carbamothioyl]-4-methyl-benzamide CAS Name: 3-chloro-N-[[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-chloro-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-methylbenzamide Traditional Name: 3-chloro-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]-4-methyl-benzamide Formula: C20H18ClN3O3S2 MolecularWeight: 447.95822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C20H18ClN3O3S2/c1-11-4-5-13(8-14(11)21)18(25)23-19(28)24-20-22-15(10-29-20)12-6-7-16(26-2)17(9-12)27-3/h4-10H,1-3H3,(H2,22,23,24,25,28)