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

Systemtic Name: 1-[(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[(6-fluorothiochroman-4-ylidene)amino]-3-(o-tolyl)thiourea CAS Name: 1-[(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[(6-fluorothiochroman-4-ylidene)amino]-3-(o-tolyl)thiourea Formula: C17H16FN3S2 MolecularWeight: 345.457443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NN=C2CCSC3=C2C=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NN=C2CCSC3=C2C=C(C=C3)F

InChI

InChI=1S/C17H16FN3S2/c1-11-4-2-3-5-14(11)19-17(22)21-20-15-8-9-23-16-7-6-12(18)10-13(15)16/h2-7,10H,8-9H2,1H3,(H2,19,21,22)