2-azanyl-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-chromen-5-one

Systemtic Name: 2-azanyl-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-chromen-5-one Openeye Name: 2-amino-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-chromen-5-one CAS Name: 2-amino-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-1-benzopyran-5-one IUPAC Name: 2-amino-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-chromen-5-one Traditional Name: 2-amino-3-(1,3-benzothiazol-2-yl)-7,7-dimethyl-4-(3-nitrophenyl)-6,8-dihydro-4H-chromen-5-one Formula: C24H21N3O4S MolecularWeight: 447.50624

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C3=NC4=CC=CC=C4S3)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C3=NC4=CC=CC=C4S3)C5=CC(=CC=C5)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C24H21N3O4S/c1-24(2)11-16(28)20-17(12-24)31-22(25)21(23-26-15-8-3-4-9-18(15)32-23)19(20)13-6-5-7-14(10-13)27(29)30/h3-10,19H,11-12,25H2,1-2H3