1-[(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-3-propan-2-yl-thiourea Openeye Name: 1-[(E)-(6-fluorothiochroman-4-ylidene)amino]-3-isopropyl-thiourea CAS Name: 1-[(E)-(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]-3-propan-2-ylthiourea IUPAC Name: 1-[(E)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]-3-propan-2-ylthiourea Traditional Name: 1-[(E)-(6-fluorothiochroman-4-ylidene)amino]-3-isopropyl-thiourea Formula: C13H16FN3S2 MolecularWeight: 297.414643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NN=C1CCSC2=C1C=C(C=C2)F

Isomeric SMILES

CC(C)NC(=S)N/N=C/1\CCSC2=C1C=C(C=C2)F

InChI

InChI=1S/C13H16FN3S2/c1-8(2)15-13(18)17-16-11-5-6-19-12-4-3-9(14)7-10(11)12/h3-4,7-8H,5-6H2,1-2H3,(H2,15,17,18)/b16-11+