7-[6-(1,4-diazepan-1-yl)indazol-1-yl]sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 7-[6-(1,4-diazepan-1-yl)indazol-1-yl]sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 7-[6-(1,4-diazepan-1-yl)indazol-1-yl]sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine CAS Name: 7-[[6-(1,4-diazepan-1-yl)-1-indazolyl]sulfonyl]-4-methyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 7-[6-(1,4-diazepan-1-yl)indazol-1-yl]sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 7-[6-(1,4-diazepan-1-yl)indazol-1-yl]sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Formula: C21H25N5O3S MolecularWeight: 427.5199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCOC2=C1C=CC(=C2)S(=O)(=O)N3C4=C(C=CC(=C4)N5CCCNCC5)C=N3

Isomeric SMILES

CN1CCOC2=C1C=CC(=C2)S(=O)(=O)N3C4=C(C=CC(=C4)N5CCCNCC5)C=N3

InChI

InChI=1S/C21H25N5O3S/c1-24-11-12-29-21-14-18(5-6-19(21)24)30(27,28)26-20-13-17(4-3-16(20)15-23-26)25-9-2-7-22-8-10-25/h3-6,13-15,22H,2,7-12H2,1H3