3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[4-(isopropylcarbamoylamino)benzyl]propionamide Formula: C16H24N4O3S MolecularWeight: 352.45176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CCSCC(=O)N

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CCSCC(=O)N

InChI

InChI=1S/C16H24N4O3S/c1-11(2)19-16(23)20-13-5-3-12(4-6-13)9-18-15(22)7-8-24-10-14(17)21/h3-6,11H,7-10H2,1-2H3,(H2,17,21)(H,18,22)(H2,19,20,23)