N-(3-chloranyl-4-methyl-phenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]propionamide Formula: C22H18ClN3OS2 MolecularWeight: 439.98082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H18ClN3OS2/c1-13-8-9-16(10-18(13)23)26-20(27)14(2)28-21-17-11-19(15-6-4-3-5-7-15)29-22(17)25-12-24-21/h3-12,14H,1-2H3,(H,26,27)