2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-N-phenylmethoxy-butanamide

Systemtic Name: 2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-N-phenylmethoxy-butanamide Openeye Name: N-benzyloxy-2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-butanamide CAS Name: 2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonylamino]-3-methyl-N-phenylmethoxybutanamide IUPAC Name: 2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonylamino]-3-methyl-N-phenylmethoxybutanamide Traditional Name: N-benzoxy-2-[1H-indol-5-ylmethyl-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-butyramide Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NOCC1=CC=CC=C1)N(CC2=CC3=C(C=C2)NC=C3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)C(C(=O)NOCC1=CC=CC=C1)N(CC2=CC3=C(C=C2)NC=C3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C28H31N3O5S/c1-20(2)27(28(32)30-36-19-21-7-5-4-6-8-21)31(18-22-9-14-26-23(17-22)15-16-29-26)37(33,34)25-12-10-24(35-3)11-13-25/h4-17,20,27,29H,18-19H2,1-3H3,(H,30,32)