N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-[[(4-methoxyanilino)-oxomethyl]amino]propanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-[(4-methoxyphenyl)carbamoylamino]propionamide Formula: C24H32N4O5S MolecularWeight: 488.59968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCNC(=O)NC2=CC=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCNC(=O)NC2=CC=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H32N4O5S/c1-18-7-8-20(17-22(18)34(31,32)28-15-5-3-4-6-16-28)26-23(29)13-14-25-24(30)27-19-9-11-21(33-2)12-10-19/h7-12,17H,3-6,13-16H2,1-2H3,(H,26,29)(H2,25,27,30)