N-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]naphthalene-2-carboxamide

Systemtic Name: N-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]naphthalene-2-carboxamide Openeye Name: N-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-2-oxo-ethyl]naphthalene-2-carboxamide CAS Name: N-[2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-2-oxoethyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-2-oxoethyl]naphthalene-2-carboxamide Traditional Name: N-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-2-keto-ethyl]-2-naphthamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CNC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CNC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H29N3O5S/c1-34-24-13-12-22(35(32,33)29-14-6-2-3-7-15-29)17-23(24)28-25(30)18-27-26(31)21-11-10-19-8-4-5-9-20(19)16-21/h4-5,8-13,16-17H,2-3,6-7,14-15,18H2,1H3,(H,27,31)(H,28,30)