N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(2,3-dimethoxyphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-2-(2,3-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(6-chlorothiochroman-4-yl)-2-(2,3-dimethoxyphenyl)thiazole-4-carboxamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-(2,3-dimethoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-2-(2,3-dimethoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(6-chlorothiochroman-4-yl)-2-(2,3-dimethoxyphenyl)thiazole-4-carboxamide Formula: C21H19ClN2O3S2 MolecularWeight: 446.97016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NC3CCSC4=C3C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)C(=O)NC3CCSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C21H19ClN2O3S2/c1-26-17-5-3-4-13(19(17)27-2)21-24-16(11-29-21)20(25)23-15-8-9-28-18-7-6-12(22)10-14(15)18/h3-7,10-11,15H,8-9H2,1-2H3,(H,23,25)