ethyl N-[2-[[5-(prop-2-ynoylamino)pyrimidin-2-yl]trisulfanyl]pyrimidin-5-yl]methanimidate

Systemtic Name: ethyl N-[2-[[5-(prop-2-ynoylamino)pyrimidin-2-yl]trisulfanyl]pyrimidin-5-yl]methanimidate Openeye Name: ethyl N-[2-[[5-(prop-2-ynoylamino)pyrimidin-2-yl]trisulfanyl]pyrimidin-5-yl]methanimidate CAS Name: N-[2-[[5-(1-oxoprop-2-ynylamino)-2-pyrimidinyl]trisulfanyl]-5-pyrimidinyl]methanimidic acid ethyl ester IUPAC Name: ethyl N-[2-[[5-(prop-2-ynoylamino)pyrimidin-2-yl]trisulfanyl]pyrimidin-5-yl]methanimidate Traditional Name: N-[2-[[5-(propioloylamino)pyrimidin-2-yl]trisulfanyl]pyrimidin-5-yl]formimidic acid ethyl ester Formula: C14H12N6O2S3 MolecularWeight: 392.47908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=CN=C(N=C1)SSSC2=NC=C(C=N2)NC(=O)C#C

Isomeric SMILES

CCOC=NC1=CN=C(N=C1)SSSC2=NC=C(C=N2)NC(=O)C#C

InChI

InChI=1S/C14H12N6O2S3/c1-3-12(21)20-11-7-17-14(18-8-11)24-25-23-13-15-5-10(6-16-13)19-9-22-4-2/h1,5-9H,4H2,2H3,(H,20,21)