N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-4-(2-cyclopentyloxy-3-methoxy-phenyl)butanamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-4-(2-cyclopentyloxy-3-methoxy-phenyl)butanamide Openeye Name: N-(6-chlorothiochroman-4-yl)-4-[2-(cyclopentoxy)-3-methoxy-phenyl]butanamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-4-(2-cyclopentyloxy-3-methoxyphenyl)butanamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-4-(2-cyclopentyloxy-3-methoxyphenyl)butanamide Traditional Name: N-(6-chlorothiochroman-4-yl)-4-[2-(cyclopentoxy)-3-methoxy-phenyl]butyramide Formula: C25H30ClNO3S MolecularWeight: 460.0286

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC2CCCC2)CCCC(=O)NC3CCSC4=C3C=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC(=C1OC2CCCC2)CCCC(=O)NC3CCSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C25H30ClNO3S/c1-29-22-10-4-6-17(25(22)30-19-8-2-3-9-19)7-5-11-24(28)27-21-14-15-31-23-13-12-18(26)16-20(21)23/h4,6,10,12-13,16,19,21H,2-3,5,7-9,11,14-15H2,1H3,(H,27,28)