4-(1-ethylindol-5-yl)sulfonyl-N-[(3-methoxyphenyl)methyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[(3-methoxyphenyl)methyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[(3-methoxyphenyl)methyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[(1-ethyl-5-indolyl)sulfonyl]-N-[(3-methoxyphenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[(3-methoxyphenyl)methyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(1-ethylindol-5-yl)sulfonyl-N-m-anisyl-1,4-diazepane-1-carboxamide Formula: C24H30N4O4S MolecularWeight: 470.5844

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NCC4=CC(=CC=C4)OC

Isomeric SMILES

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NCC4=CC(=CC=C4)OC

InChI

InChI=1S/C24H30N4O4S/c1-3-26-13-10-20-17-22(8-9-23(20)26)33(30,31)28-12-5-11-27(14-15-28)24(29)25-18-19-6-4-7-21(16-19)32-2/h4,6-10,13,16-17H,3,5,11-12,14-15,18H2,1-2H3,(H,25,29)