2-azanyl-4-(4-methoxy-3-nitro-phenyl)-4H-[1]benzothiolo[3,2-b]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-methoxy-3-nitro-phenyl)-4H-[1]benzothiolo[3,2-b]pyran-3-carbonitrile Openeye Name: 2-amino-4-(4-methoxy-3-nitro-phenyl)-4H-benzothiopheno[3,2-b]pyran-3-carbonitrile CAS Name: 2-amino-4-(4-methoxy-3-nitrophenyl)-4H-[1]benzothiolo[3,2-b]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(4-methoxy-3-nitrophenyl)-4H-[1]benzothiolo[3,2-b]pyran-3-carbonitrile Traditional Name: 2-amino-4-(4-methoxy-3-nitro-phenyl)-4H-benzothiopheno[3,2-b]pyran-3-carbonitrile Formula: C19H13N3O4S MolecularWeight: 379.38922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(=C(OC3=C2SC4=CC=CC=C43)N)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(=C(OC3=C2SC4=CC=CC=C43)N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O4S/c1-25-14-7-6-10(8-13(14)22(23)24)16-12(9-20)19(21)26-17-11-4-2-3-5-15(11)27-18(16)17/h2-8,16H,21H2,1H3