4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one

Systemtic Name: 4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Openeye Name: 4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one CAS Name: 4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one IUPAC Name: 4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Traditional Name: 4-(4-dimethylaminophenyl)-1,3-dimethyl-2,4-dihydropyrazolo[3,4-e][1,4]thiazepin-7-one Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(SCC(=O)N=C2N(N1)C)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC1=C2C(SCC(=O)N=C2N(N1)C)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C16H20N4OS/c1-10-14-15(11-5-7-12(8-6-11)19(2)3)22-9-13(21)17-16(14)20(4)18-10/h5-8,15,18H,9H2,1-4H3