N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methylsulfanyl]ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methylsulfanyl]acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methylthio]acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methylsulfanyl]acetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methylthio]acetamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSCC(=O)NC3=C(N(N=C3C)C4=CC=CC=C4)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSCC(=O)NC3=C(N(N=C3C)C4=CC=CC=C4)C)C(C)C

InChI

InChI=1S/C27H29N3O3S/c1-16(2)22-13-23-20(12-26(32)33-24(23)11-17(22)3)14-34-15-25(31)28-27-18(4)29-30(19(27)5)21-9-7-6-8-10-21/h6-13,16H,14-15H2,1-5H3,(H,28,31)