N-(1-azanyl-3-methyl-1-oxidanylidene-butan-2-yl)-1-(3-methylbut-2-enoyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide

Systemtic Name: N-(1-azanyl-3-methyl-1-oxidanylidene-butan-2-yl)-1-(3-methylbut-2-enoyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide Openeye Name: N-(1-carbamoyl-2-methyl-propyl)-1-(3-methylbut-2-enoyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide CAS Name: N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(3-methyl-1-oxobut-2-enyl)-4-[[[3-(methylthio)anilino]-oxomethyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(3-methylbut-2-enoyl)-4-[(3-methylsulfanylphenyl)carbamoylamino]pyrrolidine-2-carboxamide Traditional Name: N-(1-carbamoyl-2-methyl-propyl)-1-(3-methylbut-2-enoyl)-4-[[3-(methylthio)phenyl]carbamoylamino]pyrrolidine-2-carboxamide Formula: C23H33N5O4S MolecularWeight: 475.60422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N)NC(=O)C1CC(CN1C(=O)C=C(C)C)NC(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CC(C)C(C(=O)N)NC(=O)C1CC(CN1C(=O)C=C(C)C)NC(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C23H33N5O4S/c1-13(2)9-19(29)28-12-16(11-18(28)22(31)27-20(14(3)4)21(24)30)26-23(32)25-15-7-6-8-17(10-15)33-5/h6-10,14,16,18,20H,11-12H2,1-5H3,(H2,24,30)(H,27,31)(H2,25,26,32)