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

Systemtic Name: 1-butyl-3-[(Z)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]thiourea Openeye Name: 1-butyl-3-[(Z)-(6-fluorothiochroman-4-ylidene)amino]thiourea CAS Name: 1-butyl-3-[(Z)-(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]thiourea IUPAC Name: 1-butyl-3-[(Z)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]thiourea Traditional Name: 1-butyl-3-[(Z)-(6-fluorothiochroman-4-ylidene)amino]thiourea Formula: C14H18FN3S2 MolecularWeight: 311.441223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C1CCSC2=C1C=C(C=C2)F

Isomeric SMILES

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

InChI

InChI=1S/C14H18FN3S2/c1-2-3-7-16-14(19)18-17-12-6-8-20-13-5-4-10(15)9-11(12)13/h4-5,9H,2-3,6-8H2,1H3,(H2,16,18,19)/b17-12-