methyl (NZ)-N-[[(4-methylphenyl)carbamoylamino]-prop-2-ynylsulfanyl-methylidene]carbamate

Systemtic Name: methyl (NZ)-N-[[(4-methylphenyl)carbamoylamino]-prop-2-ynylsulfanyl-methylidene]carbamate Openeye Name: methyl (NZ)-N-[prop-2-ynylsulfanyl-(p-tolylcarbamoylamino)methylene]carbamate CAS Name: (NZ)-N-[[[(4-methylanilino)-oxomethyl]amino]-(prop-2-ynylthio)methylidene]carbamic acid methyl ester IUPAC Name: methyl (NZ)-N-[[(4-methylphenyl)carbamoylamino]-prop-2-ynylsulfanylmethylidene]carbamate Traditional Name: (NZ)-N-[(propargylthio)-(p-tolylcarbamoylamino)methylene]carbamic acid methyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC(=NC(=O)OC)SCC#C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N/C(=N/C(=O)OC)/SCC#C

InChI

InChI=1S/C14H15N3O3S/c1-4-9-21-13(17-14(19)20-3)16-12(18)15-11-7-5-10(2)6-8-11/h1,5-8H,9H2,2-3H3,(H2,15,16,17,18,19)