2-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-N-phenylmethoxy-butanamide

Systemtic Name: 2-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-N-phenylmethoxy-butanamide Openeye Name: N-benzyloxy-2-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]-3-oxo-propyl]-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-butanamide CAS Name: 2-[[3-[4-(2-hydroxyethyl)-1-piperazinyl]-3-oxopropyl]-(4-methoxyphenyl)sulfonylamino]-3-methyl-N-phenylmethoxybutanamide IUPAC Name: 2-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]-3-oxopropyl]-(4-methoxyphenyl)sulfonylamino]-3-methyl-N-phenylmethoxybutanamide Traditional Name: N-benzoxy-2-[[3-[4-(2-hydroxyethyl)piperazino]-3-keto-propyl]-(4-methoxyphenyl)sulfonyl-amino]-3-methyl-butyramide Formula: C28H40N4O7S MolecularWeight: 576.7048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NOCC1=CC=CC=C1)N(CCC(=O)N2CCN(CC2)CCO)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)C(C(=O)NOCC1=CC=CC=C1)N(CCC(=O)N2CCN(CC2)CCO)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H40N4O7S/c1-22(2)27(28(35)29-39-21-23-7-5-4-6-8-23)32(40(36,37)25-11-9-24(38-3)10-12-25)14-13-26(34)31-17-15-30(16-18-31)19-20-33/h4-12,22,27,33H,13-21H2,1-3H3,(H,29,35)