1-[[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[[(3S)-6-chloranyl-3,4-dihydro-2H-chromen-3-yl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[(3S)-6-chlorochromane-3-carbonyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[[(3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-yl]-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[(3S)-6-chloro-3,4-dihydro-2H-chromene-3-carbonyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[(3S)-6-chlorochroman-3-carbonyl]amino]-3-isoamyl-thiourea Formula: C16H22ClN3O2S MolecularWeight: 355.88278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1CC2=C(C=CC(=C2)Cl)OC1

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)[C@H]1CC2=C(C=CC(=C2)Cl)OC1

InChI

InChI=1S/C16H22ClN3O2S/c1-10(2)5-6-18-16(23)20-19-15(21)12-7-11-8-13(17)3-4-14(11)22-9-12/h3-4,8,10,12H,5-7,9H2,1-2H3,(H,19,21)(H2,18,20,23)/t12-/m0/s1