methyl (2R,3S)-2-[2-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[2-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]acetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C11H17N4O3S2- MolecularWeight: 317.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=N[N-]C(=N)S1

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)CSC1=N[N-]C(=N)S1

InChI

InChI=1S/C11H18N4O3S2/c1-4-6(2)8(9(17)18-3)13-7(16)5-19-11-15-14-10(12)20-11/h6,8H,4-5H2,1-3H3,(H3,12,13,14,16)/p-1/t6-,8+/m0/s1