methyl N-[4-(3-azanyl-4-oxidanylidene-4-phenylazanyl-butyl)sulfonylphenyl]carbamate

Systemtic Name: methyl N-[4-(3-azanyl-4-oxidanylidene-4-phenylazanyl-butyl)sulfonylphenyl]carbamate Openeye Name: methyl N-[4-(3-amino-4-anilino-4-oxo-butyl)sulfonylphenyl]carbamate CAS Name: N-[4-(3-amino-4-anilino-4-oxobutyl)sulfonylphenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-(3-amino-4-anilino-4-oxobutyl)sulfonylphenyl]carbamate Traditional Name: N-[4-(3-amino-4-anilino-4-keto-butyl)sulfonylphenyl]carbamic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(C(=O)NC2=CC=CC=C2)N

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)CCC(C(=O)NC2=CC=CC=C2)N

InChI

InChI=1S/C18H21N3O5S/c1-26-18(23)21-14-7-9-15(10-8-14)27(24,25)12-11-16(19)17(22)20-13-5-3-2-4-6-13/h2-10,16H,11-12,19H2,1H3,(H,20,22)(H,21,23)