methyl 2-[2-(carbamothioylcarbamoyl)-5-methyl-indol-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(carbamothioylcarbamoyl)-5-methyl-indol-1-yl]ethanoate Openeye Name: methyl 2-[2-(carbamothioylcarbamoyl)-5-methyl-indol-1-yl]acetate CAS Name: 2-[2-[(carbamothioylamino)-oxomethyl]-5-methyl-1-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(carbamothioylcarbamoyl)-5-methylindol-1-yl]acetate Traditional Name: 2-[5-methyl-2-(thiocarbamoylcarbamoyl)indol-1-yl]acetic acid methyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(=S)N)CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(=S)N)CC(=O)OC

InChI

InChI=1S/C14H15N3O3S/c1-8-3-4-10-9(5-8)6-11(13(19)16-14(15)21)17(10)7-12(18)20-2/h3-6H,7H2,1-2H3,(H3,15,16,19,21)