N-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-1,3-benzothiazol-2-amine

Systemtic Name: N-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-1,3-benzothiazol-2-amine Openeye Name: N-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-1,3-benzothiazol-2-amine CAS Name: N-(6,7-dimethoxy-4-quinazolinyl)-6-nitro-1,3-benzothiazol-2-amine IUPAC Name: N-(6,7-dimethoxyquinazolin-4-yl)-6-nitro-1,3-benzothiazol-2-amine Traditional Name: (6,7-dimethoxyquinazolin-4-yl)-(6-nitro-1,3-benzothiazol-2-yl)amine Formula: C17H13N5O4S MolecularWeight: 383.38122

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C17H13N5O4S/c1-25-13-6-10-12(7-14(13)26-2)18-8-19-16(10)21-17-20-11-4-3-9(22(23)24)5-15(11)27-17/h3-8H,1-2H3,(H,18,19,20,21)