7-azanyl-3,3-dimethyl-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol

Systemtic Name: 7-azanyl-3,3-dimethyl-1,1-bis(oxidanylidene)-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Openeye Name: 7-amino-3,3-dimethyl-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol CAS Name: 7-amino-3,3-dimethyl-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol IUPAC Name: 7-amino-3,3-dimethyl-1,1-dioxo-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Traditional Name: 7-amino-1,1-diketo-3,3-dimethyl-5-phenyl-4,5-dihydro-2H-1$l^{6}-benzothiepin-4-ol Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CS(=O)(=O)C2=C(C=C(C=C2)N)C(C1O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CS(=O)(=O)C2=C(C=C(C=C2)N)C(C1O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H21NO3S/c1-18(2)11-23(21,22)15-9-8-13(19)10-14(15)16(17(18)20)12-6-4-3-5-7-12/h3-10,16-17,20H,11,19H2,1-2H3