4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one

Systemtic Name: 4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Openeye Name: 4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one CAS Name: 4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one IUPAC Name: 4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Traditional Name: 4-(4-bromophenyl)-1-cyclopentyl-3-methyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Formula: C18H20BrN3OS MolecularWeight: 406.3399

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(SCC(=O)N=C2N(N1)C3CCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C2C(SCC(=O)N=C2N(N1)C3CCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H20BrN3OS/c1-11-16-17(12-6-8-13(19)9-7-12)24-10-15(23)20-18(16)22(21-11)14-4-2-3-5-14/h6-9,14,17,21H,2-5,10H2,1H3