2-azanyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Openeye Name: 2-amino-1-(3-morpholinosulfonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile CAS Name: 2-amino-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolo[3,2-b]quinoxalinecarbonitrile IUPAC Name: 2-amino-1-(3-morpholin-4-ylsulfonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Traditional Name: 2-amino-1-(3-morpholinosulfonylphenyl)pyrrolo[3,2-b]quinoxaline-3-carbonitrile Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)N3C(=C(C4=NC5=CC=CC=C5N=C43)C#N)N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)N3C(=C(C4=NC5=CC=CC=C5N=C43)C#N)N

InChI

InChI=1S/C21H18N6O3S/c22-13-16-19-21(25-18-7-2-1-6-17(18)24-19)27(20(16)23)14-4-3-5-15(12-14)31(28,29)26-8-10-30-11-9-26/h1-7,12H,8-11,23H2