6-(3-ethyl-6-piperazin-1-yl-indol-1-yl)sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine

Systemtic Name: 6-(3-ethyl-6-piperazin-1-yl-indol-1-yl)sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Openeye Name: 6-(3-ethyl-6-piperazin-1-yl-indol-1-yl)sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine CAS Name: 6-[[3-ethyl-6-(1-piperazinyl)-1-indolyl]sulfonyl]-4-methyl-2,3-dihydro-1,4-benzoxazine IUPAC Name: 6-(3-ethyl-6-piperazin-1-ylindol-1-yl)sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Traditional Name: 6-(3-ethyl-6-piperazino-indol-1-yl)sulfonyl-4-methyl-2,3-dihydro-1,4-benzoxazine Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2=C1C=CC(=C2)N3CCNCC3)S(=O)(=O)C4=CC5=C(C=C4)OCCN5C

Isomeric SMILES

CCC1=CN(C2=C1C=CC(=C2)N3CCNCC3)S(=O)(=O)C4=CC5=C(C=C4)OCCN5C

InChI

InChI=1S/C23H28N4O3S/c1-3-17-16-27(21-14-18(4-6-20(17)21)26-10-8-24-9-11-26)31(28,29)19-5-7-23-22(15-19)25(2)12-13-30-23/h4-7,14-16,24H,3,8-13H2,1-2H3