1-[(2R)-1-methoxypropan-2-yl]-3-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-[(2R)-1-methoxypropan-2-yl]-3-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoylamino]thiourea Openeye Name: 1-[(1R)-2-methoxy-1-methyl-ethyl]-3-[[2-(3-methyl-4-oxo-phthalazin-1-yl)acetyl]amino]thiourea CAS Name: 1-[(2R)-1-methoxypropan-2-yl]-3-[[2-(3-methyl-4-oxo-1-phthalazinyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-[(2R)-1-methoxypropan-2-yl]-3-[[2-(3-methyl-4-oxophthalazin-1-yl)acetyl]amino]thiourea Traditional Name: 1-[[2-(4-keto-3-methyl-phthalazin-1-yl)acetyl]amino]-3-[(1R)-2-methoxy-1-methyl-ethyl]thiourea Formula: C16H21N5O3S MolecularWeight: 363.43464

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=S)NNC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

C[C@H](COC)NC(=S)NNC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C16H21N5O3S/c1-10(9-24-3)17-16(25)19-18-14(22)8-13-11-6-4-5-7-12(11)15(23)21(2)20-13/h4-7,10H,8-9H2,1-3H3,(H,18,22)(H2,17,19,25)/t10-/m1/s1