1-[[6-(3-methylphenyl)thieno[3,2-d]pyrimidin-4-yl]amino]-3-(oxolan-2-ylmethyl)thiourea

Systemtic Name: 1-[[6-(3-methylphenyl)thieno[3,2-d]pyrimidin-4-yl]amino]-3-(oxolan-2-ylmethyl)thiourea Openeye Name: 1-[[6-(m-tolyl)thieno[3,2-d]pyrimidin-4-yl]amino]-3-(tetrahydrofuran-2-ylmethyl)thiourea CAS Name: 1-[[6-(3-methylphenyl)-4-thieno[3,2-d]pyrimidinyl]amino]-3-(2-oxolanylmethyl)thiourea IUPAC Name: 1-[[6-(3-methylphenyl)thieno[3,2-d]pyrimidin-4-yl]amino]-3-(oxolan-2-ylmethyl)thiourea Traditional Name: 1-[[6-(m-tolyl)thieno[3,2-d]pyrimidin-4-yl]amino]-3-(tetrahydrofurfuryl)thiourea Formula: C19H21N5OS2 MolecularWeight: 399.53294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC3=C(S2)C(=NC=N3)NNC(=S)NCC4CCCO4

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC3=C(S2)C(=NC=N3)NNC(=S)NCC4CCCO4

InChI

InChI=1S/C19H21N5OS2/c1-12-4-2-5-13(8-12)16-9-15-17(27-16)18(22-11-21-15)23-24-19(26)20-10-14-6-3-7-25-14/h2,4-5,8-9,11,14H,3,6-7,10H2,1H3,(H2,20,24,26)(H,21,22,23)