1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-prop-2-enyl-1-propyl-thiourea

Systemtic Name: 1-[6-azanyl-2,4-bis(oxidanylidene)-1-(phenylmethyl)pyrimidin-5-yl]-3-prop-2-enyl-1-propyl-thiourea Openeye Name: 3-allyl-1-(6-amino-1-benzyl-2,4-dioxo-pyrimidin-5-yl)-1-propyl-thiourea CAS Name: 1-[6-amino-2,4-dioxo-1-(phenylmethyl)-5-pyrimidinyl]-3-prop-2-enyl-1-propylthiourea IUPAC Name: 1-(6-amino-1-benzyl-2,4-dioxopyrimidin-5-yl)-3-prop-2-enyl-1-propylthiourea Traditional Name: 3-allyl-1-(6-amino-1-benzyl-2,4-diketo-pyrimidin-5-yl)-1-propyl-thiourea Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NCC=C

Isomeric SMILES

CCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=S)NCC=C

InChI

InChI=1S/C18H23N5O2S/c1-3-10-20-18(26)22(11-4-2)14-15(19)23(17(25)21-16(14)24)12-13-8-6-5-7-9-13/h3,5-9H,1,4,10-12,19H2,2H3,(H,20,26)(H,21,24,25)